N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide

Systemtic Name: N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide Openeye Name: N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide CAS Name: N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-5-(2-fluorophenyl)-2-furancarboxamide IUPAC Name: N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide Traditional Name: N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]-5-(2-fluorophenyl)-2-furamide Formula: C23H21ClFN3O2S MolecularWeight: 457.948143

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=CC=C4F)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=CC=C4F)Cl

InChI

InChI=1S/C23H21ClFN3O2S/c24-17-14-15(8-9-19(17)28-12-4-1-5-13-28)26-23(31)27-22(29)21-11-10-20(30-21)16-6-2-3-7-18(16)25/h2-3,6-11,14H,1,4-5,12-13H2,(H2,26,27,29,31)